Gadolinium(III) nitrate hexahydrate

Catalog Number	ACM19598904-3
CAS	19598-90-4
Structure
Synonyms	Gadolinium hexahydrate trinitrate
IUPAC Name	Gadolinium(3+);trinitrate;hexahydrate
Molecular Weight	451.4
Molecular Formula	GdH12N3O15
Canonical SMILES	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Gd+3]
InChI	InChI=1S/Gd.3NO3.6H₂O/c;3*2-1(3)4;/h;6*1H2/q+3;3*-1;
InChI Key	XWFVFZQEDMDSET-UHFFFAOYSA-N
Melting Point	91 °C
Purity	99%+
Density	2.406 g/mL at 25 °C (lit.)
Solubility	Soluble in water
Appearance	White crystals or crystalline powder
Storage	0-6 °C
Complexity	18.8
Covalently-Bonded Unit Count	10
Defined Atom Stereocenter Count	0
Exact Mass	451.95095
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	15
Hydrogen Bond Donor Count	6
Monoisotopic Mass	451.95095
Rotatable Bond Count	0
Topological Polar Surface Area	195 Ų